6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine

C12H21N3 — CID 103936975

IUPAC6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine
SMILESCCCN(C)c1ccc([C@@H](N)CC)nc1
InChIInChI=1S/C12H21N3/c1-4-8-15(3)10-6-7-12(14-9-10)11(13)5-2/h6-7,9,11H,4-5,8,13H2,1-3H3/t11-/m0/s1
InChIKeyMDGSIYJIIGEECF-NSHDSACASA-N
MW207.32 g/mol
LogP2.34
Rot. Bonds5

About 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine

6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine (PubChem CID 103936975) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine.

Molecular Properties

Compound Name6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine
PubChem CID103936975
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine
SMILESCCCN(C)c1ccc([C@@H](N)CC)nc1
InChIInChI=1S/C12H21N3/c1-4-8-15(3)10-6-7-12(14-9-10)11(13)5-2/h6-7,9,11H,4-5,8,13H2,1-3H3/t11-/m0/s1
InChIKeyMDGSIYJIIGEECF-NSHDSACASA-N
XLogP2.34
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-[methyl(propyl)amino]-2-pyridinyl]propan-1-ol
CID 112585264
6-(1-aminopropyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-3-amine
CID 112584377
6-[(1R)-1-aminopropyl]-N,N-dibutylpyridin-3-amine
CID 103936956
6-[(1R)-1-aminopropyl]-N-(cyclopropylmethyl)-N-methylpyridin-3-amine
CID 103937043
6-[(1R)-1-aminopropyl]-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-3-amine
CID 103937486
6-(1-aminopropyl)-N,N-diethylpyridin-3-amine
CID 112584036
6-(1-aminopropyl)-N-propyl-N-prop-2-ynylpyridin-3-amine
CID 112584549
6-[(1R)-1-aminopropyl]-N-methyl-N-(4-methylcyclohexyl)pyridin-3-amine
CID 103937109
6-[(1S)-1-aminopropyl]-N-methyl-N-(2-methylbutan-2-yl)pyridin-3-amine
CID 103937401
6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 103937054
6-[(1S)-1-aminopropyl]-N-[(2-bromophenyl)methyl]-N-methylpyridin-3-amine
CID 103937072
1-[[[6-[(1S)-1-aminopropyl]-3-pyridinyl]-methylamino]methyl]cyclopentan-1-ol
CID 104985411

Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine?
The IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine (CID 103936975) is 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine.
What is the SMILES notation for 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine?
The canonical SMILES for 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine is CCCN(C)c1ccc([C@@H](N)CC)nc1.
What is the InChIKey of 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine?
The InChIKey is MDGSIYJIIGEECF-NSHDSACASA-N. The full InChI is InChI=1S/C12H21N3/c1-4-8-15(3)10-6-7-12(14-9-10)11(13)5-2/h6-7,9,11H,4-5,8,13H2,1-3H3/t11-/m0/s1.
What are the key properties of 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine?
6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine has a molecular weight of 207.32 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine is sourced from PubChem (CID 103936975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).